3-(2-bromophenyl)-5-[(4-methoxyphenyl)methylsulfanyl]-4-(phenylmethyl)-1,2,4-triazole

Systemtic Name: 3-(2-bromophenyl)-5-[(4-methoxyphenyl)methylsulfanyl]-4-(phenylmethyl)-1,2,4-triazole Openeye Name: 4-benzyl-3-(2-bromophenyl)-5-[(4-methoxyphenyl)methylsulfanyl]-1,2,4-triazole CAS Name: 3-(2-bromophenyl)-5-[(4-methoxyphenyl)methylthio]-4-(phenylmethyl)-1,2,4-triazole IUPAC Name: 4-benzyl-3-(2-bromophenyl)-5-[(4-methoxyphenyl)methylsulfanyl]-1,2,4-triazole Traditional Name: 4-benzyl-3-(2-bromophenyl)-5-(p-anisylthio)-1,2,4-triazole Formula: C23H20BrN3OS MolecularWeight: 466.3934

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CSC2=NN=C(N2CC3=CC=CC=C3)C4=CC=CC=C4Br

Isomeric SMILES

COC1=CC=C(C=C1)CSC2=NN=C(N2CC3=CC=CC=C3)C4=CC=CC=C4Br

InChI

InChI=1S/C23H20BrN3OS/c1-28-19-13-11-18(12-14-19)16-29-23-26-25-22(20-9-5-6-10-21(20)24)27(23)15-17-7-3-2-4-8-17/h2-14H,15-16H2,1H3